477662

Source:http://linkedlifedata.com/resource/chembl/compound/477662

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Named Graph Language Inference

Statements in which the resource exists as a subject.
Predicate	Object
rdf:type	chembl:ChemicalCompound
chemicalCompound:standardIn...	InChI=1S/C42H34O11/c1-48-32-33(49-38(43)27-17-7-2-8-18-27)35(51-40(45)29-21-11-4-12-22-29)37(53-42(47)31-25-15-6-16-26-31)36(52-41(46)30-23-13-5-14-24-30)34(32)50-39(44)28-19-9-3-10-20-28/h2-26,32-37H,1H3/t32-,33-,34+,35-,36-,37+/m1/s1
chemicalCompound:standardIn...	DTUQOINNPRMWFZ-HILYAGTESA-N
chemicalCompound:canonicalS...	CO[C@@H]1[C@@H](OC(=O)c2ccccc2)[C@H](OC(=O)c3ccccc3)[C@@H](OC(=O)c4ccccc4)[C@@H](OC(=O)c5ccccc5)[C@@H]1OC(=O)c6ccccc6
chemicalCompound:molecularF...	C42H34O11
chemicalCompound:moleculeId	477662
chemicalCompound:mwFreebase	714.713
chemicalCompound:alogp	7.561
chemicalCompound:hba	11
chemicalCompound:hbd	0
chemicalCompound:psa	140.72
chemicalCompound:rtb	16
chemicalCompound:ro3Pass	N
chemicalCompound:numRo5viol...	3
chemicalCompound:medChemFri...	Y
chemicalCompound:acdLogP	10.195
chemicalCompound:acdLogD	10.195
chemicalCompound:fullMwt	714.713
chemicalCompound:chemblId	CHEMBL505274
chemicalCompound:maxPhase	0
chemicalCompound:therapeuti...	0
chemicalCompound:dosedIngre...	No
chemicalCompound:structureT...	structureType:MOL
chemicalCompound:chebi	https://linkedlifedata.com/resource/chebi/id/CHEBI:577662
chemicalCompound:moleculeTy...	moleculeType:Small molecule
chemicalCompound:oral	No
chemicalCompound:parenteral	No
chemicalCompound:topical	No
chemicalCompound:blackBoxWa...	No
chemicalCompound:naturalPro...	No
chemicalCompound:proDrug	No
chemicalCompound:activity	activity:2283002, activity:2283006